SCHEMBL345894

SCHEMBL345894

NCCSSCCN(Cl)Cl

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.56
THPO P40225 1/20 0.56
MAPT P10636 2/20 0.53
EHMT2 Q96KQ7 1/20 0.53
TDP1 Q9NUW8 1/20 0.53

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Cystamine SCHEMBL3648870 0.74 TSHR (1.00) TSHRTHPOMAPTEHMT2TDP1
Cystamine SCHEMBL11040994 0.74
Cystamine SCHEMBL43866 0.74
SCHEMBL18210498 0.72 TSHR (0.56) TSHRTHPOMAPTEHMT2TDP1
SCHEMBL14516806 0.72 TSHR (0.56) TSHRTHPOMAPTEHMT2TDP1
Cystamine SCHEMBL28597938 0.72 TSHR (0.77) TSHRTHPOMAPTEHMT2TDP1
Cystamine SCHEMBL9193499 0.71
Cystamine SCHEMBL320311 0.71 MAPT (1.00) TSHRTHPOMAPTEHMT2TDP1
Cystamine SCHEMBL196510 0.71
Cystamine SCHEMBL31402311 0.71 TSHR (0.91) TSHRTHPOMAPTEHMT2TDP1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109069656-B Oral nanoparticles for gene delivery and pharmaceutical compositions comprising the same KB生物医药株式会社 2022-09-09 CN disclosed
EP-2285772-B1 NEW CLASS OF CATIONIC LIPIDS FOR TRANSPORTING ACTIVE AGENTS INTO CELLS OZ BIOSCIENCES SAS (FR) 2022-07-13 EP disclosed
US-11266747-B2 Orally administered nanoparticles for gene delivery and pharmaceutical composition containing same KB BIOMED INC. (KR) 2022-03-08 US disclosed
US-20190111156-A1 Orally Administered Nanoparticles for Gene Delivery and Pharmaceutical Composition Containing Same KB BIOMED INC. (KR) 2019-04-18 US disclosed
CN-109069656-A Oral nanoparticles for gene delivery and pharmaceutical compositions comprising the same KB生物医药株式会社 2018-12-21 CN disclosed
EP-3017307-B1 3-ARYL PROPIOLONITRILE COMPOUNDS FOR THIOL LABELING UNIV STRASBOURG (FR) 2018-11-21 EP disclosed
US-10131626-B2 3-aryl propiolonitrile compounds for thiol labeling UNIVERSITE DE STRASBOURG (FR) 2018-11-20 US disclosed
US-20170210700-A1 3-ARYL PROPIOLONITRILE COMPOUNDS FOR THIOL LABELING CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2017-07-27 US disclosed
US-9663454-B2 3-aryl propiolonitrile compounds for thiol labeling UNIVERSITE DE STRASBOURG (FR) 2017-05-30 US disclosed
US-20160145199-A1 3-ARYL PROPIOLONITRILE COMPOUNDS FOR THIOL LABELING UNIVERSITE DE STRASBOURG (FR) 2016-05-26 US disclosed
US-7745590-B1 Degradable macromolecular magnetic resonance imaging contrast agents and methods thereof UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2010-06-29 US disclosed
US-6982324-B1 Degradable macromolecular magnetic resonance imaging contrast agents and methods thereof UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2006-01-03 US disclosed
EP-0650485-B1 2,5-DIARYL TETRAHYDRO-THIOPHENES, -FURANS AND ANALOGS FOR THE TREATMENT OF INFLAMMATORY AND IMMUNE DISORDERS CYTOMED INC (US) 2000-10-11 EP disclosed
US-5856323-A PAF RECEPTOR ANTAGONISTS, INHIBITING THE ENZYME 5-LIPOXYGENASE CYTOMED, INC. (US) 1999-01-05 US disclosed
US-5434151-A Treatment of immune and inflammatory disorders, aryl substituted tetrahydrofurans, tetrahydrothiophenes, cyclopentanes, pyrrolidines CYTOMED, INC. (US) 1995-07-18 US disclosed
EP-0650485-A1 2,5-DIARYL TETRAHYDRO-THIOPHENES, -FURANS AND ANALOGS FOR THE TREATMENT OF INFLAMMATORY AND IMMUNE DISORDERS CYTOMED, INC. (US) 1995-05-03 EP disclosed
US-5358938-A 2,5-Diaryl tetrahydrofurans, tetrahydrothiophenes, 1,3-cyclo-pentanes and pyrrolidines CYTOMED, INC. (US) 1994-10-25 US disclosed
WO-1994001430-A1 2,5-DIARYL TETRAHYDRO-THIOPHENES, -FURANS AND ANALOGS FOR THE TREATMENT OF INFLAMMATORY AND IMMUNE DISORDERS CYTOMED, INC. (US) 1994-01-20 WO disclosed
US-4837316-A ANTIULCER AGENTS FUJIREBIO KABUSHIKI KAISHA (JP) 1989-06-06 US disclosed
EP-0214823-A2 Alkylamide derivatives with H2-receptor antagonistic and cytoprotective action FUJIREBIO KABUSHIKI KAISHA also trading as FUJIREBIO INC. (JP) 1987-03-18 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10131626-B2 3-aryl propiolonitrile compounds for thiol labeling PTMS, TST, PNN TSHR 2315/4885THPO 2814/4885MAPT 885/4885
US-20170210700-A1 3-ARYL PROPIOLONITRILE COMPOUNDS FOR THIOL LABELING PTMS, TST, PNN TSHR 2315/4885THPO 2814/4885MAPT 885/4885
US-20160145199-A1 3-ARYL PROPIOLONITRILE COMPOUNDS FOR THIOL LABELING PTMS, TST, PNN TSHR 2315/4885THPO 2814/4885MAPT 885/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.